| CAS Number | 919836-45-6 |
| Catalog Number | AG01BUIS |
| Chemical Name | 1-methyl-N-(prop-2-yn-1-yl)piperidin-4-amine |
| IUPAC Name | 1-methyl-N-prop-2-ynylpiperidin-4-amine |
| InChI | InChI=1S/C9H16N2/c1-3-6-10-9-4-7-11(2)8-5-9/h1,9-10H,4-8H2,2H3 |
| InChI Key | HUOBAQJEADYYMG-UHFFFAOYSA-N |
| MDL Number | MFCD11137808 |
| Molecular Formula | C9H16N2 |
| Molecular Weight | 152.2367 |
| SMILES | CN1CCC(NCC#C)CC1 |
| Synonyms | 1-methyl-N-(prop-2-yn-1-yl)piperidin-4-amine,
919836-45-6,
4-Piperidinamine, 1-methyl-N-2-propyn-1-yl-,
SCHEMBL4624158,
HUOBAQJEADYYMG-UHFFFAOYSA-N,
ZINC19875373,
AKOS000223440,
(1-methylpiperidin-4-yl)propargylamine,
F8882-0128,
|
| Complexity | 148 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 152.131g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 152.241g/mol |
| Monoisotopic Mass | 152.131g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 15.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number